Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 3/20 | 0.39 |
| ▸ | AURKA | O14965 | 2/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.39 |
| ▸ | CFTR | P13569 | 3/20 | 0.34 |
| ▸ | ULK1 | O75385 | 2/20 | 0.33 |
| ▸ | ULK2 | Q8IYT8 | 2/20 | 0.33 |
| ▸ | MAPK3 | P27361 | 3/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 2/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30776172 | 0.83 | AURKA (0.39) | KDRAURKAAURKBCFTRPIK3CA | |
| SCHEMBL27233788 | 0.77 | AURKA (0.39) | KDRAURKAAURKBCFTRULK1 | |
| SCHEMBL29208694 | 0.75 | AURKA (0.38) | KDRAURKAAURKBCFTRULK1 | |
| SCHEMBL29768997 | 0.75 | TRPA1 (0.46) | PIK3CANFE2L2 | |
| SCHEMBL14810676 | 0.75 | TRPA1 (0.46) | PIK3CANFE2L2 | |
| SCHEMBL29769000 | 0.75 | TRPA1 (0.34) | AURKAAURKBPIK3CA | |
| SCHEMBL5942469 | 0.75 | AURKA (0.42) | KDRAURKAAURKBULK1MAPK3 | |
| SCHEMBL15156962 | 0.75 | CFTR (0.37) | KDRAURKAAURKBCFTRPIK3CA | |
| SCHEMBL21031170 | 0.75 | AURKA (0.40) | KDRAURKAAURKBCFTRPIK3CA | |
| SCHEMBL24968231 | 0.74 | AURKA (0.37) | KDRAURKAAURKBCFTRPIK3CA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117777099-A | PARP7 inhibitors and uses thereof | 诺沃斯达药业(上海)有限公司 | 2024-03-29 | — | — | CN | disclosed |